N-(3-chloranyl-4-methoxy-phenyl)-3-(ethylsulfanylmethyl)-5-(4-methoxyphenyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-3-(ethylsulfanylmethyl)-5-(4-methoxyphenyl)-1,2,3-triazole-4-carboxamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-3-(ethylsulfanylmethyl)-5-(4-methoxyphenyl)triazole-4-carboxamide CAS Name: N-(3-chloro-4-methoxyphenyl)-3-[(ethylthio)methyl]-5-(4-methoxyphenyl)-4-triazolecarboxamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-3-(ethylsulfanylmethyl)-5-(4-methoxyphenyl)triazole-4-carboxamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-3-[(ethylthio)methyl]-5-(4-methoxyphenyl)triazole-4-carboxamide Formula: C20H21ClN4O3S MolecularWeight: 432.92374

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Descriptors Computed from Structure

Canonical SMILES:

CCSCN1C(=C(N=N1)C2=CC=C(C=C2)OC)C(=O)NC3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

CCSCN1C(=C(N=N1)C2=CC=C(C=C2)OC)C(=O)NC3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C20H21ClN4O3S/c1-4-29-12-25-19(18(23-24-25)13-5-8-15(27-2)9-6-13)20(26)22-14-7-10-17(28-3)16(21)11-14/h5-11H,4,12H2,1-3H3,(H,22,26)